(4-phenylmethoxycarbonylphenyl) 4,4-dimethyl-2,3-dihydrothiochromene-6-carboxylate

Systemtic Name: (4-phenylmethoxycarbonylphenyl) 4,4-dimethyl-2,3-dihydrothiochromene-6-carboxylate Openeye Name: (4-benzyloxycarbonylphenyl) 4,4-dimethylthiochromane-6-carboxylate CAS Name: 4,4-dimethyl-2,3-dihydro-1-benzothiopyran-6-carboxylic acid (4-phenylmethoxycarbonylphenyl) ester IUPAC Name: (4-phenylmethoxycarbonylphenyl) 4,4-dimethyl-2,3-dihydrothiochromene-6-carboxylate Traditional Name: 4,4-dimethylthiochroman-6-carboxylic acid (4-carbobenzoxyphenyl) ester Formula: C26H24O4S MolecularWeight: 432.53136

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCSC2=C1C=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4)C

Isomeric SMILES

CC1(CCSC2=C1C=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4)C

InChI

InChI=1S/C26H24O4S/c1-26(2)14-15-31-23-13-10-20(16-22(23)26)25(28)30-21-11-8-19(9-12-21)24(27)29-17-18-6-4-3-5-7-18/h3-13,16H,14-15,17H2,1-2H3